N2-(3-methylbutyl)-5-nitro-N4-[[(2R)-oxolan-2-yl]methyl]pyrimidine-2,4,6-triamine

Systemtic Name: N2-(3-methylbutyl)-5-nitro-N4-[[(2R)-oxolan-2-yl]methyl]pyrimidine-2,4,6-triamine Openeye Name: N2-isopentyl-5-nitro-N4-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrimidine-2,4,6-triamine CAS Name: N2-(3-methylbutyl)-5-nitro-N4-[[(2R)-2-oxolanyl]methyl]pyrimidine-2,4,6-triamine IUPAC Name: 2-N-(3-methylbutyl)-5-nitro-4-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-2,4,6-triamine Traditional Name: [6-amino-2-(isoamylamino)-5-nitro-pyrimidin-4-yl]-[[(2R)-tetrahydrofuran-2-yl]methyl]amine Formula: C14H24N6O3 MolecularWeight: 324.37876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=C(C(=N1)NCC2CCCO2)[N+](=O)[O-])N

Isomeric SMILES

CC(C)CCNC1=NC(=C(C(=N1)NC[C@H]2CCCO2)[N+](=O)[O-])N

InChI

InChI=1S/C14H24N6O3/c1-9(2)5-6-16-14-18-12(15)11(20(21)22)13(19-14)17-8-10-4-3-7-23-10/h9-10H,3-8H2,1-2H3,(H4,15,16,17,18,19)/t10-/m1/s1